2-[2-(2-methylpropylsulfanyl)-4-oxidanylidene-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-(2-methylpropylsulfanyl)-4-oxidanylidene-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-(2-isobutylsulfanyl-4-oxo-thiazol-5-yl)acetic acid CAS Name: 2-[2-(2-methylpropylthio)-4-oxo-5-thiazolyl]acetic acid IUPAC Name: 2-[2-(2-methylpropylsulfanyl)-4-oxo-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-(isobutylthio)-4-keto-2-thiazolin-5-yl]acetic acid Formula: C9H13NO3S2 MolecularWeight: 247.33442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC(=O)C(S1)CC(=O)O

Isomeric SMILES

CC(C)CSC1=NC(=O)C(S1)CC(=O)O

InChI

InChI=1S/C9H13NO3S2/c1-5(2)4-14-9-10-8(13)6(15-9)3-7(11)12/h5-6H,3-4H2,1-2H3,(H,11,12)